6-(4-methoxy-3,5-dimethylphenyl)-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyridine-2-carboxamide

C23H22N4O2 — CID 42690200

IUPAC6-(4-methoxy-3,5-dimethylphenyl)-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyridine-2-carboxamide
SMILESCOc1c(C)cc(-c2ccc3nc(C(=O)NCc4ccncc4)cn3c2)cc1C
InChIInChI=1S/C23H22N4O2/c1-15-10-19(11-16(2)22(15)29-3)18-4-5-21-26-20(14-27(21)13-18)23(28)25-12-17-6-8-24-9-7-17/h4-11,13-14H,12H2,1-3H3,(H,25,28)
InChIKeyDCNIPKNJCPADEQ-UHFFFAOYSA-N
MW386.46 g/mol
LogP3.95
Rot. Bonds5

About 6-(4-methoxy-3,5-dimethylphenyl)-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyridine-2-carboxamide

6-(4-methoxy-3,5-dimethylphenyl)-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyridine-2-carboxamide (PubChem CID 42690200) has the molecular formula C23H22N4O2 and a molecular weight of 386.46 g/mol. Its IUPAC name is 6-(4-methoxy-3,5-dimethylphenyl)-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyridine-2-carboxamide.

Molecular Properties

Compound Name6-(4-methoxy-3,5-dimethylphenyl)-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyridine-2-carboxamide
PubChem CID42690200
Molecular FormulaC23H22N4O2
Molecular Weight386.46 g/mol
Exact Mass386.17
IUPAC Name6-(4-methoxy-3,5-dimethylphenyl)-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyridine-2-carboxamide
SMILESCOc1c(C)cc(-c2ccc3nc(C(=O)NCc4ccncc4)cn3c2)cc1C
InChIInChI=1S/C23H22N4O2/c1-15-10-19(11-16(2)22(15)29-3)18-4-5-21-26-20(14-27(21)13-18)23(28)25-12-17-6-8-24-9-7-17/h4-11,13-14H,12H2,1-3H3,(H,25,28)
InChIKeyDCNIPKNJCPADEQ-UHFFFAOYSA-N
XLogP3.95
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.46
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-(4-methoxy-3,5-dimethylphenyl)-N-(pyridin-2-ylmethyl)imidazo[1,2-a]pyridine-2-carboxamide
CID 42690204
6-(4-methoxy-3,5-dimethylphenyl)-N-(2-pyridin-2-ylethyl)imidazo[1,2-a]pyridine-2-carboxamide
CID 42690197
N-benzyl-6-(2,6-dimethoxyphenyl)imidazo[1,2-a]pyridine-2-carboxamide
CID 42876569
2-methoxy-3,5-dimethyl-N-(pyridin-4-ylmethyl)benzamide
CID 110762827
N-[(3,4-dimethoxyphenyl)methyl]-6-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 42536396
2-[4-[4-[2-[(4-methoxyphenyl)methylcarbamoyl]imidazo[1,2-a]pyridin-6-yl]phenyl]cyclohexyl]acetic acid
CID 71695669
3-[4-[2-[(4-fluorophenyl)methylcarbamoyl]imidazo[1,2-a]pyridin-6-yl]phenyl]propanoic acid
CID 118720503
N-[(4-chlorophenyl)methyl]-6-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 53014872
(4-benzylpiperidin-1-yl)-[6-(4-methoxy-3,5-dimethylphenyl)imidazo[1,2-a]pyridin-2-yl]methanone
CID 42690193
2-(4-methoxy-2,3,5-trimethylphenyl)-N-(pyridin-4-ylmethyl)acetamide
CID 110769367
N-benzyl-7-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 1172225
6-methoxy-N-[(4-methylphenyl)methyl]imidazo[1,2-b]pyridazine-2-carboxamide
CID 87051013

Frequently Asked Questions

What is the IUPAC name of 6-(4-methoxy-3,5-dimethylphenyl)-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyridine-2-carboxamide?
The IUPAC name of 6-(4-methoxy-3,5-dimethylphenyl)-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyridine-2-carboxamide (CID 42690200) is 6-(4-methoxy-3,5-dimethylphenyl)-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyridine-2-carboxamide.
What is the SMILES notation for 6-(4-methoxy-3,5-dimethylphenyl)-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyridine-2-carboxamide?
The canonical SMILES for 6-(4-methoxy-3,5-dimethylphenyl)-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyridine-2-carboxamide is COc1c(C)cc(-c2ccc3nc(C(=O)NCc4ccncc4)cn3c2)cc1C.
What is the InChIKey of 6-(4-methoxy-3,5-dimethylphenyl)-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyridine-2-carboxamide?
The InChIKey is DCNIPKNJCPADEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N4O2/c1-15-10-19(11-16(2)22(15)29-3)18-4-5-21-26-20(14-27(21)13-18)23(28)25-12-17-6-8-24-9-7-17/h4-11,13-14H,12H2,1-3H3,(H,25,28).
What are the key properties of 6-(4-methoxy-3,5-dimethylphenyl)-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyridine-2-carboxamide?
6-(4-methoxy-3,5-dimethylphenyl)-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyridine-2-carboxamide has a molecular weight of 386.46 g/mol, XLogP of 3.95, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-methoxy-3,5-dimethylphenyl)-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyridine-2-carboxamide is sourced from PubChem (CID 42690200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).